COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL234002
Chemical Name: 6,6-dimethyl-5,7-dinitro-2-(thiophen-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: [O-][N+](=O)C12CN3CC(C2(C)C)(CN(C1)C3c1cccs1)[N+](=O)[O-]

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Molecular Weight: 338.39
Empirical Formula: C14H18N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.126
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 126
Number of rings: 5

     

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